SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ibs'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
11GS_B_EAAB211_1
(GLUTATHIONE
S-TRANSFERASE)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		4 / 7 TYR A 186
GLY A 140
ARG A 188
GLY A 115
 None
 0.53A 11gsB-3ibsA:
undetectable		 11gsB-3ibsA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EE2_A_CHDA1150_0
(ALCOHOL
DEHYDROGENASE)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		5 / 11 LEU A  42
LEU A 139
SER A 200
VAL A  47
ILE A 110
 None
 1.14A 1ee2A-3ibsA:
2.5		 1ee2A-3ibsA:
22.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EE2_B_CHDB1250_1
(ALCOHOL
DEHYDROGENASE)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		5 / 11 LEU A  42
LEU A 139
SER A 200
VAL A  47
ILE A 110
 None
 1.16A 1ee2B-3ibsA:
2.0		 1ee2B-3ibsA:
22.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N4H_A_REAA500_1
(NUCLEAR RECEPTOR
ROR-BETA)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		5 / 11 ILE A 199
ALA A 195
VAL A 187
ARG A 188
ALA A 179
 None
 1.13A 1n4hA-3ibsA:
undetectable		 1n4hA-3ibsA:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P6K_A_ACTA860_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		4 / 6 GLY A 106
GLN A 135
ALA A 207
SER A 209
 None
 0.99A 1p6kA-3ibsA:
undetectable		 1p6kA-3ibsA:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1S1X_A_NVPA999_1
(REVERSE
TRANSCRIPTASE)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		4 / 8 LEU A  12
VAL A 141
GLY A 140
LEU A  28
 None
 0.96A 1s1xA-3ibsA:
undetectable		 1s1xA-3ibsA:
17.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AZX_A_TRPA602_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		4 / 8 LEU A  19
ILE A 149
GLU A 116
ILE A  14
 None
 0.88A 2azxA-3ibsA:
undetectable		 2azxA-3ibsA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2R2V_D_ACTD37_0
(GCN4 LEUCINE ZIPPER)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		3 / 3 LYS A  30
ARG A 188
VAL A 141
 CL  A 216 ( 3.9A)
None
None
 0.95A 2r2vC-3ibsA:
undetectable
2r2vD-3ibsA:
undetectable		 2r2vC-3ibsA:
8.72
2r2vD-3ibsA:
8.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XKW_B_P1BB1475_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		5 / 12 ILE A 112
SER A 204
ALA A 207
LEU A  42
ILE A 110
 None
 1.00A 2xkwB-3ibsA:
undetectable		 2xkwB-3ibsA:
21.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JW3_B_TOPB208_1
(DIHYDROFOLATE
REDUCTASE)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		5 / 9 MET A  49
LEU A  42
ILE A 199
LEU A  34
ILE A  10
 None
None
None
CL  A 216 ( 4.3A)
None
 1.27A 3jw3B-3ibsA:
2.1		 3jw3B-3ibsA:
22.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N9J_B_EAAB214_1
(GLUTATHIONE
S-TRANSFERASE P)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		4 / 8 TYR A 186
GLY A 140
ARG A 188
GLY A 115
 None
 0.54A 3n9jB-3ibsA:
undetectable		 3n9jB-3ibsA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ASD_A_BAXA1500_2
(VASCULAR ENDOTHELIAL
GROWTH FACTOR
RECEPTOR 2)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		4 / 6 ILE A 203
VAL A  47
LEU A  60
ILE A  10
 None
 0.81A 4asdA-3ibsA:
undetectable		 4asdA-3ibsA:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KIC_B_SAMB401_0
(METHYLTRANSFERASE
MPPJ)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		5 / 12 ILE A 199
GLY A 184
ILE A 109
ALA A 108
ALA A 126
 None
 1.11A 4kicB-3ibsA:
undetectable		 4kicB-3ibsA:
22.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Z2E_F_TR6F101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
SYMMETRIZED E-SITE
DNA)		 3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB
(Bacteroides
thetaiotaomicron) 		4 / 5 GLY A 142
ARG A 188
GLY A 140
GLU A 172
 None
 1.00A 4z2eB-3ibsA:
undetectable
4z2eC-3ibsA:
undetectable		 4z2eB-3ibsA:
18.79
4z2eC-3ibsA:
22.10